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2,2,2-Trifluoroethyl 2-({[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]amino}carbonyl)cyclohexanecarboxylate
SpectraBase Compound ID 2rC8IF5Jr4R
InChI InChI=1S/C21H24ClF3N2O3/c1-12-13(14-7-4-8-17(22)18(14)27-12)9-10-26-19(28)15-5-2-3-6-16(15)20(29)30-11-21(23,24)25/h4,7-8,15-16,27H,2-3,5-6,9-11H2,1H3,(H,26,28)
InChIKey SPRRXHSRYFFKFG-UHFFFAOYSA-N
Mol Weight 444.88 g/mol
Molecular Formula C21H24ClF3N2O3
Exact Mass 444.142755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IVFDCIMacZq
Name 2,2,2-Trifluoroethyl 2-({[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]amino}carbonyl)cyclohexanecarboxylate
Alternate Name(s) 2,2,2-trifluoroethyl 2-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohexane-1-carboxylate 2,2,2-trifluoroethyl 2-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohexanecarboxylate 2,2,2-tris(fluoranyl)ethyl 2-[2-(7-chloranyl-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohexane-1-carboxylate 2-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethylcarbamoyl]cyclohexanecarboxylic acid 2,2,2-trifluoroethyl ester 2-[[2-(7-chloro-2-methyl-1H-indol-3-yl)ethylamino]-oxomethyl]-1-cyclohexanecarboxylic acid 2,2,2-trifluoroethyl ester
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Formula C21H24ClF3N2O3
InChI InChI=1S/C21H24ClF3N2O3/c1-12-13(14-7-4-8-17(22)18(14)27-12)9-10-26-19(28)15-5-2-3-6-16(15)20(29)30-11-21(23,24)25/h4,7-8,15-16,27H,2-3,5-6,9-11H2,1H3,(H,26,28)
InChIKey SPRRXHSRYFFKFG-UHFFFAOYSA-N
Molecular Weight 444.882 g/mol
SMILES N(C(=O)C1C(CCCC1)C(OCC(F)(F)F)=O)CCc1c([nH]c2c1cccc2Cl)C
SPLASH splash10-0006-3900000000-14b7dd25f1ab19bf1ba7
Wiley ID 1445818